Vitas-M small molecule compound
(2E)-3-{4-[(4-chlorobenzyl)oxy]phenyl}-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK180911
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1)Cl)/C(=O)NCC1CCCO1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H21ClN2O3 MW 396.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O3/c23-19-7-3-17(4-8-19)15-28-20-9-5-16(6-10-20)12-18(13-24)22(26)25-14-21-2-1-11-27-21/h3-10,12,21H,1-2,11,14-15H2,(H,25,26)/b18-12+InChIKey
DKYLBPHJHOJMLZ-LDADJPATSA-NSynonyms
444179-83-3(2E)3(4((4CHLOROBENZYL)OXY)PHENYL)2CYANON(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(E)3(4((4CHLOROPHENYL)METHOXY)PHENYL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
444179833
C1CC(OC1)CNC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)C#N
InChI=1SC22H21ClN2O3c23197317(4819)1528209516(61020)1218(1324)22(26)25142121112721h3101221H12111415H2(H2526)b1812+
MFCD03181762
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1)Cl)C(=O)NCC1CCCO1
ZINC000002807786
ZINC000002807788
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